Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.51 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.39 |
| ▸ | WNT3A | P56704 | 1/20 | 0.39 |
| ▸ | CLEC4M | Q9H2X3 | 1/20 | 0.38 |
| ▸ | GABRA1 | P14867 | 3/20 | 0.36 |
| ▸ | GABRB2 | P47870 | 3/20 | 0.36 |
| ▸ | JAK2 | O60674 | 1/20 | 0.36 |
| ▸ | JAK3 | P52333 | 1/20 | 0.36 |
| ▸ | GABRB1 | P18505 | 2/20 | 0.36 |
| ▸ | GABRA3 | P34903 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.34 |
| ▸ | PKM | P14618 | 1/20 | 0.34 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL1350659 | 0.87 | KDM4E (0.67) | KDM4ECTNNB1WNT3ACLEC4MGABRA1 | |
| SCHEMBL12606659 | 0.81 | CTNNB1 (0.42) | KDM4ECTNNB1WNT3AMEN1ALDH1A1 | |
| SCHEMBL12606657 | 0.79 | KDM4E (0.47) | KDM4ECLEC4MJAK2JAK3NR4A2 | |
| SCHEMBL12606661 | 0.78 | PBRM1 (0.46) | KDM4ECTNNB1WNT3AMEN1ALDH1A1 | |
| SCHEMBL1353154 | 0.77 | CYP1A2 (0.51) | KDM4ECTNNB1WNT3AMEN1ALDH1A1 | |
| SCHEMBL29464955 | 0.76 | ALDH1A1 (0.46) | KDM4ECTNNB1WNT3AMEN1ALDH1A1 | |
| SCHEMBL27847428 | 0.75 | GPR84 (0.40) | KDM4ECTNNB1WNT3AJAK2JAK3 | |
| SCHEMBL2285923 | 0.73 | CLEC4M (0.55) | KDM4ECLEC4MGABRA1GABRB2JAK2 | |
| SCHEMBL11793589 | 0.72 | CTNNB1 (0.49) | KDM4ECTNNB1WNT3AMEN1ALDH1A1 | |
| SCHEMBL12134085 | 0.70 | CFTR (0.52) | KDM4EALDH1A1TP53HPGD |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8884018-B2 | Process for preparing modulators of cystic fibrosis transmembrane conductance regulator | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2014-11-11 | — | — | US | disclosed |